UCSF

ZINC53993659

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.90 5.26 -4.82 2 3 0 52 227.691 5

Vendor Notes

Note Type Comments Provided By
Melting_Point 166-168? Alfa-Aesar
Melting_Point 166-168° Alfa-Aesar
MP 168-170 °C(lit.) Indofine
MP 186-189 °C(lit.) Indofine

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )